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3-Chloro-tetracyclo[3.2.0.0(2,7).0(4,6)]heptan
SpectraBase Compound ID CxwnKDZVKsx
InChI InChI=1S/C7H7Cl/c8-7-5-1-2(5)4-3(1)6(4)7/h1-7H/t1-,2+,3-,4+,5+,6-,7-
InChIKey GPXFQESLHDNAKS-JXWMKKMJSA-N
Mol Weight 126.59 g/mol
Molecular Formula C7H7Cl
Exact Mass 126.023628 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K8KJQhavSnw
Name 3-Chloro-tetracyclo[3.2.0.0(2,7).0(4,6)]heptan
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7Cl
InChI InChI=1S/C7H7Cl/c8-7-5-1-2(5)4-3(1)6(4)7/h1-7H/t1-,2+,3-,4+,5+,6-,7-
InChIKey GPXFQESLHDNAKS-JXWMKKMJSA-N
Literature Reference DOI 10.1002/cber.19901230124
Molecular Weight 126.586 g/mol
SMILES [C@@]12([C@]3([C@]2(C([C@@]2([C@@]1([C@@]32[H])[H])[H])Cl)[H])[H])[H]
SPLASH splash10-0006-9100000000-cbf3cd20c20cb521567b
Source of Spectrum K-123-129-31a
Synonyms (1R,5S,6S,7S)-3-chlorotetracyclo[3.2.0.0(2,7).0(4,6)]heptane
Wiley ID 1796850